Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 4/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.36 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | MGAM | O43451 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | SI | P14410 | 1/20 | 0.33 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL14182153 | 0.82 | TSHR (0.44) | TSHRKMT2ALMNAMEN1CA12 | |
| SCHEMBL15539095 | 0.81 | TSHR (0.52) | TSHRKMT2AEPHX2LMNAMEN1 | |
| SCHEMBL29013243 | 0.80 | CYP2C19 (0.36) | TSHRCYP2C19MAPT | |
| SCHEMBL14865334 | 0.80 | TSHR (0.46) | TSHRKMT2AEPHX2LMNAMEN1 | |
| SCHEMBL26556778 | 0.79 | CYP2C19 (0.56) | TSHRCYP2C19EPHX2LMNACYP4F2 | |
| SCHEMBL12573961 | 0.79 | CYP2C19 (0.56) | TSHRCYP2C19EPHX2LMNACYP4F2 | |
| SCHEMBL14563343 | 0.78 | TSHR (0.44) | TSHRKMT2AEPHX2LMNAMEN1 | |
| SCHEMBL3447711 | 0.78 | TSHR (0.44) | TSHRKMT2AEPHX2LMNAMEN1 | |
| SCHEMBL8895232 | 0.78 | TSHR (0.44) | TSHRKMT2AEPHX2LMNAMEN1 | |
| SCHEMBL5505303 | 0.78 | TSHR (0.48) | TSHRKMT2AEPHX2LMNAMEN1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115850120-A | Preparation method of alcohol alpha-carbon hydrogen bond alkylated compound | 浙江工业大学 | 2023-03-28 | — | — | CN | disclosed |